| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 30th, 2009 | 14 | Yes |
Popular Name: 2-Carbomethoxy-3-tropinone 2-Carbomethoxy-3-tropinone
Find On: PubMed — Wikipedia — Google
CAS Numbers: 36127-17-0 , [36127-17-0]
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.25 | 3.33 | -7.62 | 0 | 4 | 0 | 47 | 197.234 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.84 | 5.75 | -38.12 | 1 | 4 | 0 | 54 | 197.234 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0756596A1; EP0885220A1; US5736556; WO1997030997A1 | IBM Patent Data |
